Geometry

Info

ID:

9112

ICSD:

412742

Name:

Iron(III) phosphate(V) - beta

Comp.:

Fe1O4P1

Symm.:

 P6422(181)

Latt.:

 hexagonal

Spin:

 14.500

Eg/Eg':

2.777/2.714 eV

me/mh:

56.920/-11.283

K-data

high symmetry path:

G - A - L - M - G - K - H - A

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 H: -0.333 0.667 0.5 K: -0.333 0.667 0.0 M: 0.0 0.5 0.0 L: 0.0 0.5 0.5

DOS

Bands